2-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[[5-oxo-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-[(4-benzyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-[2-(2-thienyl)ethyl]acetamide Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC(=O)NCCC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H18N4O2S2/c22-15(18-9-8-14-7-4-10-24-14)12-25-17-20-19-16(23)21(17)11-13-5-2-1-3-6-13/h1-7,10H,8-9,11-12H2,(H,18,22)(H,19,23)